(2R,3R)-2-pyridin-4-yloxolan-3-amine

C9H12N2O — CID 124708910

IUPAC(2R,3R)-2-pyridin-4-yloxolan-3-amine
SMILESN[C@@H]1CCO[C@@H]1c1ccncc1
InChIInChI=1S/C9H12N2O/c10-8-3-6-12-9(8)7-1-4-11-5-2-7/h1-2,4-5,8-9H,3,6,10H2/t8-,9-/m1/s1
InChIKeyDNJJXTGHLCEGKC-RKDXNWHRSA-N
MW164.21 g/mol
LogP0.87
Rot. Bonds1

About (2R,3R)-2-pyridin-4-yloxolan-3-amine

(2R,3R)-2-pyridin-4-yloxolan-3-amine (PubChem CID 124708910) has the molecular formula C9H12N2O and a molecular weight of 164.21 g/mol. Its IUPAC name is (2R,3R)-2-pyridin-4-yloxolan-3-amine.

Molecular Properties

Compound Name(2R,3R)-2-pyridin-4-yloxolan-3-amine
PubChem CID124708910
Molecular FormulaC9H12N2O
Molecular Weight164.21 g/mol
Exact Mass164.09
IUPAC Name(2R,3R)-2-pyridin-4-yloxolan-3-amine
SMILESN[C@@H]1CCO[C@@H]1c1ccncc1
InChIInChI=1S/C9H12N2O/c10-8-3-6-12-9(8)7-1-4-11-5-2-7/h1-2,4-5,8-9H,3,6,10H2/t8-,9-/m1/s1
InChIKeyDNJJXTGHLCEGKC-RKDXNWHRSA-N
XLogP0.87
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R,3S)-2-pyridin-4-yloxolan-3-amine
CID 119032003
(2R,3R)-2-pyridin-4-yloxan-3-amine
CID 124709129
(2S,3S)-2-pyridin-3-yloxolan-3-amine
CID 124511858
2-(4-cyclopropylphenyl)oxolan-3-amine
CID 79978303
4-(3-propan-2-yloxolan-2-yl)pyridine
CID 164726214
(2R,3S)-2-phenyloxan-3-amine
CID 131044940
2-(5-bromo-3-pyridinyl)oxolan-3-amine;dihydrochloride
CID 122236370
2-(3,4-difluorophenyl)oxolan-3-amine
CID 71683254
2-(3-chlorophenyl)oxolan-3-amine
CID 79364588
5-(3-aminooxolan-2-yl)-1H-pyridin-2-one
CID 122235365
(2R,3S)-2-(1-methylpyrazol-4-yl)oxolan-3-amine;dihydrochloride
CID 86775431
(2S,3R)-2-(4-methylphenyl)oxan-3-amine
CID 95757199

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-2-pyridin-4-yloxolan-3-amine?
The IUPAC name of (2R,3R)-2-pyridin-4-yloxolan-3-amine (CID 124708910) is (2R,3R)-2-pyridin-4-yloxolan-3-amine.
What is the SMILES notation for (2R,3R)-2-pyridin-4-yloxolan-3-amine?
The canonical SMILES for (2R,3R)-2-pyridin-4-yloxolan-3-amine is N[C@@H]1CCO[C@@H]1c1ccncc1.
What is the InChIKey of (2R,3R)-2-pyridin-4-yloxolan-3-amine?
The InChIKey is DNJJXTGHLCEGKC-RKDXNWHRSA-N. The full InChI is InChI=1S/C9H12N2O/c10-8-3-6-12-9(8)7-1-4-11-5-2-7/h1-2,4-5,8-9H,3,6,10H2/t8-,9-/m1/s1.
What are the key properties of (2R,3R)-2-pyridin-4-yloxolan-3-amine?
(2R,3R)-2-pyridin-4-yloxolan-3-amine has a molecular weight of 164.21 g/mol, XLogP of 0.87, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-2-pyridin-4-yloxolan-3-amine is sourced from PubChem (CID 124708910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).